CHEMBL5992821 [448349]
CHEMBL5992821
| SMILES | COc1cccc(N2CCc3c(C(F)(F)F)ccc(N4CCN(C(=O)Cn5cnc6cccnc65)[C@H](C)C4)c3C2)c1 |
| InChIKey | QSGDWMVCONKCJN-HXUWFJFHSA-N |
Chemical Properties
| Hydrogen bond acceptors | 7 |
| Hydrogen bond donors | 0 |
| Rotatable bonds | 5 |
| Log P | 4.759 |
| Molecular weight (Da) | 564.2 |
| Stereochemistry info | full |
Database connections
Bioactivities
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| Protein | Gene | Species | Family | Class | Type | Min | Avg | Max | Database |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| Protein | Gene | Species | Family | Class | Type | Min | Avg | Max | Database |
CHEMBL5992821
Drug properties
| Molecular type | Small molecule |
| Physiological/Surrogate | Surrogate |
| Approved drug | No |
Distribution across phases (no. indications)
Phase I
0
Phase II
0
Phase III
0
Phase IV
0